Geometry & MOs

Info

ID:	168032
PubChem CID:	74914722
Reduced:	FNO4H22C26 (1)
Stoich.:	ABC4D22E26 (1)
Weight, g/mol:	427.178358
ΔH_f, kcal/mol:	-110.74
Dipole, Da:	4.59
IP(EA), eV:	-8.76(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[6-methoxy-3-(4-methoxyphenyl)-1-benzofuran-5-yl]-N-(2-methylphenyl)but-2-enamide

Drug info:

PubChemData

Smile

CC(=CC(=O)NC1=CC(=CC=C1)F)C2=C(C=C3C(=C2)C(=CO3)C4=CC=C(C=C4)OC)OC

DOS

IR

Vibrations